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88974-88-3 | 1,2,4-Triazolo[4,3-a]pyridine, 3-(2-methylphenyl)-
CAS No: 88974-88-3 Catalog No: AG0046KH MDL No:
Product Description
Catalog Number:
AG0046KH
Chemical Name:
1,2,4-Triazolo[4,3-a]pyridine, 3-(2-methylphenyl)-
CAS Number:
88974-88-3
Molecular Formula:
C13H11N3
Molecular Weight:
209.2465
IUPAC Name:
3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine
InChI:
InChI=1S/C13H11N3/c1-10-6-2-3-7-11(10)13-15-14-12-8-4-5-9-16(12)13/h2-9H,1H3
InChI Key:
CPOKTQDJBJTEOM-UHFFFAOYSA-N
SMILES:
Cc1ccccc1c1nnc2n1cccc2
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.252g/mol
Monoisotopic Mass:
209.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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